SCHEMBL22809770

SCHEMBL22809770

COc1ccc(Oc2cccc(C(F)(F)F)c2)c(F)c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.62
L3MBTL1 Q9Y468 4/20 0.62
NPSR1 Q6W5P4 1/20 0.62
RAB9A P51151 1/20 0.51
KDM4E B2RXH2 3/20 0.49
LMNA P02545 1/20 0.49
SCN8A Q9UQD0 4/20 0.45
SCN10A Q9Y5Y9 4/20 0.45
POLB P06746 1/20 0.44
TEAD1 P28347 1/20 0.43
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PPP1CA P62136 1/20 0.43
KMT2A Q03164 1/20 0.43
PPARG P37231 1/20 0.42
P2RY1 P47900 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15832050 0.84 L3MBTL1 (0.60) MAPTL3MBTL1NPSR1RAB9AKDM4E
SCHEMBL13791556 0.82 L3MBTL1 (0.65) MAPTL3MBTL1NPSR1RAB9AKDM4E
SCHEMBL24999539 0.82 L3MBTL1 (0.51) MAPTL3MBTL1NPSR1RAB9AKDM4E
SCHEMBL167016 0.82 L3MBTL1 (0.58) MAPTL3MBTL1NPSR1RAB9AKDM4E
SCHEMBL29782607 0.82 L3MBTL1 (0.58) MAPTL3MBTL1NPSR1RAB9AKDM4E
SCHEMBL15832087 0.82 L3MBTL1 (0.50) MAPTL3MBTL1NPSR1KDM4EPOLB
SCHEMBL28920293 0.81 L3MBTL1 (0.68) MAPTL3MBTL1NPSR1RAB9AKDM4E
SCHEMBL30010505 0.81 L3MBTL1 (0.68) MAPTL3MBTL1NPSR1RAB9AKDM4E
SCHEMBL2576322 0.81 MAPT (0.52) MAPTL3MBTL1NPSR1RAB9ALMNA
SCHEMBL27295380 0.81 MAPT (0.57) MAPTL3MBTL1NPSR1RAB9AKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3239134-B1 PYRIDONE AMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMA (US) 2020-12-23 EP disclosed